3-[6-(4-pyridin-4-ylpiperazin-1-yl)pyrimidin-4-yl]benzenecarbonitrile

Systemtic Name: 3-[6-(4-pyridin-4-ylpiperazin-1-yl)pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 3-[6-[4-(4-pyridyl)piperazin-1-yl]pyrimidin-4-yl]benzonitrile CAS Name: 3-[6-(4-pyridin-4-yl-1-piperazinyl)-4-pyrimidinyl]benzonitrile IUPAC Name: 3-[6-(4-pyridin-4-ylpiperazin-1-yl)pyrimidin-4-yl]benzonitrile Traditional Name: 3-[6-[4-(4-pyridyl)piperazino]pyrimidin-4-yl]benzonitrile Formula: C20H18N6 MolecularWeight: 342.39712

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C3=NC=NC(=C3)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C3=NC=NC(=C3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H18N6/c21-14-16-2-1-3-17(12-16)19-13-20(24-15-23-19)26-10-8-25(9-11-26)18-4-6-22-7-5-18/h1-7,12-13,15H,8-11H2